2-[5-methyl-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyrazol-1-yl]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[5-methyl-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-pyrazol-1-yl]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-[5-methyl-3-(4-methylpiperazin-4-ium-1-carbonyl)pyrazol-1-yl]-N-(2-pyridylmethyl)acetamide CAS Name: 2-[5-methyl-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-pyrazolyl]-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-[5-methyl-3-(4-methylpiperazin-4-ium-1-carbonyl)pyrazol-1-yl]-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-[5-methyl-3-(4-methylpiperazin-4-ium-1-carbonyl)pyrazol-1-yl]-N-(2-pyridylmethyl)acetamide Formula: C18H25N6O2+ MolecularWeight: 357.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NCC2=CC=CC=N2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)NCC2=CC=CC=N2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H24N6O2/c1-14-11-16(18(26)23-9-7-22(2)8-10-23)21-24(14)13-17(25)20-12-15-5-3-4-6-19-15/h3-6,11H,7-10,12-13H2,1-2H3,(H,20,25)/p+1